Geometry & MOs

Info

ID:	181842
PubChem CID:	76802304
Reduced:	BrFN2O2H20C22 (1)
Stoich.:	ABC2D2E20F22 (1)
Weight, g/mol:	786.541086
ΔH_f, kcal/mol:	-53.35
Dipole, Da:	1.18
IP(EA), eV:	-9.11(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2,3-di(octadec-9-enoyloxy)propoxy-hydroxyphosphoryl]oxy-2-methylpropanoic acid

Drug info:

PubChemData

Smile

C1C(CN(C1C2=NC=C(C2)C3=CC=C(C=C3)Br)C(=O)OCC4=CC=CC=C4)F

DOS

IR

Vibrations